N-[4-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[4-[2-(4-butylanilino)-2-oxo-ethyl]thiazol-2-yl]-4-fluoro-benzamide CAS Name: N-[4-[2-(4-butylanilino)-2-oxoethyl]-2-thiazolyl]-4-fluorobenzamide IUPAC Name: N-[4-[2-(4-butylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]-4-fluorobenzamide Traditional Name: N-[4-[2-(4-butylanilino)-2-keto-ethyl]thiazol-2-yl]-4-fluoro-benzamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FN3O2S/c1-2-3-4-15-5-11-18(12-6-15)24-20(27)13-19-14-29-22(25-19)26-21(28)16-7-9-17(23)10-8-16/h5-12,14H,2-4,13H2,1H3,(H,24,27)(H,25,26,28)